6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine

C13H25N5 — CID 81006405

IUPAC6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NN)c(C)c(NCC(C)CC)n1
InChIInChI=1S/C13H25N5/c1-5-7-11-16-12(15-8-9(3)6-2)10(4)13(17-11)18-14/h9H,5-8,14H2,1-4H3,(H2,15,16,17,18)
InChIKeyFHEAIBJPEIUJOI-UHFFFAOYSA-N
MW251.38 g/mol
LogP2.48
Rot. Bonds7

About 6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine

6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine (PubChem CID 81006405) has the molecular formula C13H25N5 and a molecular weight of 251.38 g/mol. Its IUPAC name is 6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine
PubChem CID81006405
Molecular FormulaC13H25N5
Molecular Weight251.38 g/mol
Exact Mass251.21
IUPAC Name6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NN)c(C)c(NCC(C)CC)n1
InChIInChI=1S/C13H25N5/c1-5-7-11-16-12(15-8-9(3)6-2)10(4)13(17-11)18-14/h9H,5-8,14H2,1-4H3,(H2,15,16,17,18)
InChIKeyFHEAIBJPEIUJOI-UHFFFAOYSA-N
XLogP2.48
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.38
LogP ≤ 52.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine (CID 81006405) is 6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine is CCCc1nc(NN)c(C)c(NCC(C)CC)n1.
What is the InChIKey of 6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine?
The InChIKey is FHEAIBJPEIUJOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N5/c1-5-7-11-16-12(15-8-9(3)6-2)10(4)13(17-11)18-14/h9H,5-8,14H2,1-4H3,(H2,15,16,17,18).
What are the key properties of 6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine?
6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine has a molecular weight of 251.38 g/mol, XLogP of 2.48, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine is sourced from PubChem (CID 81006405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).